SCHEMBL14730237

SCHEMBL14730237

CNC1CCN(c2nc(C(C)(C)C)no2)CC1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 10/20 0.39
GPR119 Q8TDV5 3/20 0.39
ALOX5AP P20292 6/20 0.38
HRH3 Q9Y5N1 1/20 0.36
KCNH2 Q12809 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14730240 0.88 GPR119 (0.42) HRH4GPR119ALOX5APHRH3
SCHEMBL6125573 0.88 GPR119 (0.38) HRH4GPR119ALOX5APHRH3
SCHEMBL12490078 0.88 GPR119 (0.39) GPR119ALOX5AP
Hydrochloric Acid SCHEMBL14723462 0.87 GPR119 (0.41) HRH4GPR119ALOX5APHRH3
Hydrochloric Acid SCHEMBL6125721 0.87 GPR119 (0.37) HRH4GPR119ALOX5APHRH3
SCHEMBL14730241 0.87 GPR119 (0.38) HRH4GPR119ALOX5APHRH3KCNH2
SCHEMBL14730328 0.84 GPR119 (0.37) HRH4GPR119ALOX5APKCNH2
SCHEMBL356316 0.81 GPR119 (0.59) GPR119ALOX5AP
SCHEMBL14990451 0.81 SMN1; SMN2 (0.46)
SCHEMBL14730239 0.77 GPR119 (0.43) HRH4GPR119

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013026587-A1 1,4 DISUBSTITUTED PYRROLIDINE - 3 - YL -AMINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS PROSIDION LIMITED (GB) 2013-02-28 WO disclosed